[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine

C11H12FN3 — CID 83882408

IUPAC[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine
SMILESCc1cnc(CN)n1-c1ccc(F)cc1
InChIInChI=1S/C11H12FN3/c1-8-7-14-11(6-13)15(8)10-4-2-9(12)3-5-10/h2-5,7H,6,13H2,1H3
InChIKeyJZNAYCKPDLTVBJ-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.78
Rot. Bonds2

About [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine

[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine (PubChem CID 83882408) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine.

Molecular Properties

Compound Name[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine
PubChem CID83882408
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine
SMILESCc1cnc(CN)n1-c1ccc(F)cc1
InChIInChI=1S/C11H12FN3/c1-8-7-14-11(6-13)15(8)10-4-2-9(12)3-5-10/h2-5,7H,6,13H2,1H3
InChIKeyJZNAYCKPDLTVBJ-UHFFFAOYSA-N
XLogP1.78
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(4-chlorophenyl)-5-methylimidazol-2-yl]ethanamine
CID 83896915
[1-(3-chlorophenyl)-5-methylimidazol-2-yl]methanamine
CID 83890397
2-[1-(4-fluorophenyl)-5-methylimidazol-2-yl]sulfanylacetic acid
CID 81337040
[2-(4-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]methanamine
CID 82470262
[1-(4-fluorophenyl)-4-methylimidazol-2-yl]methanamine
CID 163914142
(6-fluoroimidazo[1,5-a]pyridin-3-yl)methanamine
CID 83873255
3-(aminomethyl)-1-(4-fluorophenyl)-6-methylpyridazin-4-one
CID 82421897
[1-(5-fluoro-2-pyridinyl)-1,2,4-triazol-3-yl]methanamine
CID 62951079
2-[1-(4-fluorophenyl)-1,2,4-triazol-3-yl]ethanamine
CID 83820004
[2-(4-fluorophenyl)pyrazol-3-yl]methanamine
CID 83877731
3-ethyl-1-(4-fluorophenyl)-1,2,4-triazole
CID 91025299
N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 62593517

Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine?
The IUPAC name of [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine (CID 83882408) is [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine.
What is the SMILES notation for [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine?
The canonical SMILES for [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine is Cc1cnc(CN)n1-c1ccc(F)cc1.
What is the InChIKey of [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine?
The InChIKey is JZNAYCKPDLTVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-8-7-14-11(6-13)15(8)10-4-2-9(12)3-5-10/h2-5,7H,6,13H2,1H3.
What are the key properties of [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine?
[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine has a molecular weight of 205.24 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine is sourced from PubChem (CID 83882408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).